SCHEMBL3359392

SCHEMBL3359392

CC(=O)O/C=C/Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.50
ALDH1A1 P00352 4/20 0.48
TOP1 P11387 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
ARG2 P78540 1/20 0.44
LMNA P02545 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
AKR1B1 P15121 1/20 0.38
PTGS2 P35354 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 1/20 0.36
ALPI P09923 1/20 0.36
PKM P14618 1/20 0.36
PTGS1 P23219 1/20 0.36
XIAP P98170 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4254918 1.00 MAOB (0.50) MAOBALDH1A1TOP1CA1CA2
SCHEMBL3359398 1.00 MAOB (0.50) MAOBALDH1A1TOP1CA1CA2
SCHEMBL9116695 0.85 ALDH1A1 (0.37) MAOBALDH1A1TOP1CA1CA2
SCHEMBL14775423 0.85 MAOB (0.54) MAOBALDH1A1TOP1CA1CA2
SCHEMBL13834343 0.83 MAOB (0.44) MAOBALDH1A1TOP1CA1CA2
SCHEMBL3247823 0.81 ALDH1A1 (0.52) MAOBALDH1A1TOP1CA1CA2
SCHEMBL6551301 0.80 TDP1 (0.50) MAOBALDH1A1TOP1CA1CA2
SCHEMBL29273747 0.80 LMNA (0.47) MAOBALDH1A1TOP1CA1CA2
SCHEMBL13899906 0.78 RAB9A (0.38) ALDH1A1CA1CA2LMNATSHR
SCHEMBL11267329 0.77 MAOB (0.45) MAOBALDH1A1TOP1CA1CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004091307-A2 FEED ADDITIVES AGAINST DISEASSE INFECTION IN TERRESTRIAL AND AQUATIC ANIMALS ADVANCED BIONUTRITON CORPORATION (US) 2004-10-28 WO claimed
US-20150073045-A1 POLYCYCLIC COMPOUNDS AND METHODS RELATED THERETO CORNELL UNIVERSITY (US) 2015-03-12 US disclosed
US-20140128458-A1 POLYCYCLIC COMPOUNDS AND METHODS RELATED THERETO CORNELL UNIVERSITY (US) 2014-05-08 US disclosed
US-8563603-B2 Polycyclic compounds and methods related thereto CORNELL UNIVERSITY (US) 2013-10-22 US disclosed
US-20120225053-A1 COMPOSITIONS AND METHODS FOR THE PREVENTION AND TREATMENT OF CONDITIONS ASSOCIATED WITH INFLAMATION DUSHENKOV SLAVIK (US) 2012-09-06 US disclosed
WO-2010048452-A2 POLYCYCLIC COMPOUNDS AND METHODS RELATED THERETO CHAVEZ KATHRYN JILL (US) 2010-04-29 WO disclosed
US-7638114-B1 Method for disinfecting the air SCHUER JOERG PETER 2009-12-29 US disclosed
US-7351739-B2 Bioactive compounds and methods of uses thereof WELLGEN, INC. (US) 2008-04-01 US disclosed
US-20080045587-A1 PLANT PROTECTION SCHUR JORG P 2008-02-21 US disclosed
EP-1883416-A2 COMPOSITIONS AND METHODS FOR THE PREVENTION AND TREATMENT OF CONDITIONS ASSOCIATED WITH INFLAMMATION Wellgen, Inc. (US) 2008-02-06 EP disclosed
US-20020176882-A1 Additive the improvement and/or stabilization of the keeping quality of microbially perishable products SCHUR JORG PETER (DE) 2002-11-28 US disclosed
EP-0415745-B1 Process for producing alpha-beta-unsaturated carbonyl compound NIPPON ZEON CO (JP) 1994-08-03 EP disclosed
EP-0404497-B1 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO (JP) 1994-06-01 EP disclosed
EP-0428343-B1 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO (JP) 1994-05-04 EP disclosed
US-5118862-A Process for producing αβ-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1992-06-02 US disclosed
US-5118863-A Process for producing an α,β-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1992-06-02 US disclosed
EP-0415745-A2 Process for producing alpha-beta-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1991-03-06 EP disclosed
EP-0404497-A2 A process for producing an alpha,beta-unsaturated carbonyl compound NIPPON ZEON CO., LTD. (JP) 1990-12-27 EP disclosed
US-4952690-A 6-substituted thia-aza compounds CIBA-GEIGY CORPORATION (US) 1990-08-28 US disclosed
US-4692442-A ANTIBIOTICS CIBA-GEIGY CORPORATION (US) 1987-09-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150073045-A1 POLYCYCLIC COMPOUNDS AND METHODS RELATED THERETO PKD1, THPO, CCNO MAOB 3103/4885ALDH1A1 1263/4885TOP1 1149/4885
US-20140128458-A1 POLYCYCLIC COMPOUNDS AND METHODS RELATED THERETO PKD1, THPO, CCNO MAOB 3103/4885ALDH1A1 1263/4885TOP1 1149/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.